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Target
Polyunsaturated fatty acid 5-lipoxygenase
Ligand
BDBM50131688
Substrate
n/a
Meas. Tech.
ChEMBL_1867200 (CHEMBL4368175)
IC50
530±n/a nM
Citation
 Boccellino, M; Donniacuo, M; Bruno, F; Rinaldi, B; Quagliuolo, L; Ambruosi, M; Pace, S; De Rosa, M; Olgaç, A; Banoglu, E; Alessio, N; Massa, A; Kahn, H; Werz, O; Fiorentino, A; Filosa, R Protective effect of piceatannol and bioactive stilbene derivatives against hypoxia-induced toxicity in H9c2 cardiomyocytes and structural elucidation as 5-LOX inhibitors. Eur J Med Chem 180:637-647 (2019) [PubMed]  Article 
Target
Name:
Polyunsaturated fatty acid 5-lipoxygenase
Synonyms:
5-LO | 5-Lipo-oxygenase (5-LOX) | 5-Lipoxygenase (5-LO) | 5-Lipoxygenase (LOX) | 5-Lipoygenase | 5-lipoxygenase/FLAP | ALOX5 | Arachidonate 5-lipoxygenase | LOG5 | LOX5_HUMAN
Type:
Enzyme
Mol. Mass.:
77972.74
Organism:
Homo sapiens (Human)
Description:
Recombinant protein was purified from E. coli lysate. After ammonium sulfate precipitation and subsequent steps, the supernatant (S100) was used for 5-LO activity assay.
Residue:
674
Sequence:
MPSYTVTVATGSQWFAGTDDYIYLSLVGSAGCSEKHLLDKPFYNDFERGAVDSYDVTVDEELGEIQLVRIEKRKYWLNDDWYLKYITLKTPHGDYIEFPCYRWITGDVEVVLRDGRAKLARDDQIHILKQHRRKELETRQKQYRWMEWNPGFPLSIDAKCHKDLPRDIQFDSEKGVDFVLNYSKAMENLFINRFMHMFQSSWNDFADFEKIFVKISNTISERVMNHWQEDLMFGYQFLNGCNPVLIRRCTELPEKLPVTTEMVECSLERQLSLEQEVQQGNIFIVDFELLDGIDANKTDPCTLQFLAAPICLLYKNLANKIVPIAIQLNQIPGDENPIFLPSDAKYDWLLAKIWVRSSDFHVHQTITHLLRTHLVSEVFGIAMYRQLPAVHPIFKLLVAHVRFTIAINTKAREQLICECGLFDKANATGGGGHVQMVQRAMKDLTYASLCFPEAIKARGMESKEDIPYYFYRDDGLLVWEAIRTFTAEVVDIYYEGDQVVEEDPELQDFVNDVYVYGMRGRKSSGFPKSVKSREQLSEYLTVVIFTASAQHAAVNFGQYDWCSWIPNAPPTMRAPPPTAKGVVTIEQIVDTLPDRGRSCWHLGAVWALSQFQENELFLGMYPEEHFIEKPVKEAMARFRKNLEAIVSVIAERNKKKQLPYYYLSPDRIPNSVAI
  
Inhibitor
Name:
BDBM50131688
Synonyms:
(E)-4-(3,5-dimethoxystyryl)phenol | 3,5-Dimethoxy-4'-hydroxyl-trans-stilbene | 4'-hydroxy-3,5-dimethoxy stilbene | 4-(3,5-dimethoxystyryl)phenol | 4-[(E)-2-(3,5-Dimethoxy-phenyl)-vinyl]-phenol | 4-[2-(3,5-Dimethoxy-phenyl)-vinyl]-phenol | CHEMBL83527 | E 4-[2-(3,5-Dimethoxy-phenyl)-vinyl]-phenol | Pterostilben | Pterostilbene
Type:
Small organic molecule
Emp. Form.:
C16H16O3
Mol. Mass.:
256.2964
SMILES:
COc1cc(OC)cc(\C=C\c2ccc(O)cc2)c1
Structure:
Search PDB for entries with ligand similarity: